1-[(2-acetamido-6-chloranyl-7H-purin-8-yl)methoxy]ethyl ethanoate

Systemtic Name: 1-[(2-acetamido-6-chloranyl-7H-purin-8-yl)methoxy]ethyl ethanoate Openeye Name: 1-[(2-acetamido-6-chloro-7H-purin-8-yl)methoxy]ethyl acetate CAS Name: acetic acid 1-[(2-acetamido-6-chloro-7H-purin-8-yl)methoxy]ethyl ester IUPAC Name: 1-[(2-acetamido-6-chloro-7H-purin-8-yl)methoxy]ethyl acetate Traditional Name: acetic acid 1-[(2-acetamido-6-chloro-7H-purin-8-yl)methoxy]ethyl ester Formula: C12H14ClN5O4 MolecularWeight: 327.72366

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Descriptors Computed from Structure

Canonical SMILES:

CC(OCC1=NC2=C(N1)C(=NC(=N2)NC(=O)C)Cl)OC(=O)C

Isomeric SMILES

CC(OCC1=NC2=C(N1)C(=NC(=N2)NC(=O)C)Cl)OC(=O)C

InChI

InChI=1S/C12H14ClN5O4/c1-5(19)14-12-17-10(13)9-11(18-12)16-8(15-9)4-21-7(3)22-6(2)20/h7H,4H2,1-3H3,(H2,14,15,16,17,18,19)